Geometry & MOs

Info

ID:	260683
PubChem CID:	103199841
Reduced:	SN2O2C11H18 (1)
Stoich.:	AB2C2D11E18 (1)
Weight, g/mol:	268.007326
ΔH_f, kcal/mol:	-92.83
Dipole, Da:	6.03
IP(EA), eV:	-9.15(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-(3-chloro-5-methylphenyl)-1,3-thiazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CCCC(CCC)C1=NC(=C(S1)N)C(=O)O

DOS

IR

Vibrations